Vitas-M small molecule compound
2-{[3-(4-ethoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-(4-phenoxyphenyl)acetamide
Catalog ID
STK086804
SMILES CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)Oc2ccccc2)nc2c(c1=O)c1CCCCc1s2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C32H29N3O4S2 MW 583.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H29N3O4S2/c1-2-38-23-18-14-22(15-19-23)35-31(37)29-26-10-6-7-11-27(26)41-30(29)34-32(35)40-20-28(36)33-21-12-16-25(17-13-21)39-24-8-4-3-5-9-24/h3-5,8-9,12-19H,2,6-7,10-11,20H2,1H3,(H,33,36)InChIKey
YGNMITPMLSOGJR-UHFFFAOYSA-NSynonyms
2((3(4ethoxyphenyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)N(4phenoxyphenyl)acetamide
2((3(4ethoxyphenyl)4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)N(4phenoxyphenyl)acetamide
2((3(4ethoxyphenyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)N(4phenoxyphenyl)acetamide
CCOC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5)SC6=C3CCCC6
CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)Oc2ccccc2)nc2c(c1=O)c1CCCCc1s2
InChI=1SC32H29N3O4S2c123823181422(151923)3531(37)292610671127(26)4130(29)3432(35)402028(36)3321121625(171321)39248435924h35891219H267101120H21H3(H3336)
MFCD03224518
STK086804
ZINC000001869215
ZINC01869215
ZINC1869215
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.